TL;DR: 3-Bromo-2-ethoxy-4-pyridinol (CAS 100959-15-7) is a chemical compound with molecular formula C7H8BrNO2 and molecular weight 216.97385 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromo-2-ethoxy-1H-pyridin-4-one
Also Known As: 3-bromo-2-ethoxy-4-pyridinol, 4-Pyridinol, 3-bromo-2-ethoxy-, 3-bromo-2-ethoxy-1H-pyridin-4-one
| Molecular Formula | C7H8BrNO2 |
| Molecular Weight | 216.97385 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.97385 Da |
| Heavy Atoms | 11 |
| Complexity | 233.0 |
| SMILES | CCOC1=C(C(=O)C=CN1)Br |
| InChIKey | JSGYTOBYUQADKG-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-2-ethoxy-4-pyridinol. With a topological polar surface area (TPSA) of 38.3 Ų, 3-Bromo-2-ethoxy-4-pyridinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-2-ethoxy-4-pyridinol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Bromo-2-ethoxy-4-pyridinol is 100959-15-7.
The molecular formula of 3-Bromo-2-ethoxy-4-pyridinol is C7H8BrNO2.
The molecular weight of 3-Bromo-2-ethoxy-4-pyridinol is 216.97385 g/mol.
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